Propranolol mustard
TL;DR: Propranolol mustard (CAS 73631-12-6) is a chemical compound with molecular formula C17H21Cl2NO2 and molecular weight 341.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(2-chloroethyl)amino]-3-naphthalen-1-yloxypropan-2-ol
Also Known As: Propranolol mustard, 1-(Bis(2-chloroethyl)amino)-3-(naphthalen-1-yloxy)propan-2-ol, 1-(1-Naphthyloxy)-3-(bis(2-chloroethyl)amino)-2-propanol, 1-[bis(2-chloroethyl)amino]-3-naphthalen-1-yloxypropan-2-ol, 2-Propanol, 1-(bis(2-chloroethyl)amino)-3-(1-naphthalenyloxy)-
| Molecular Formula | C17H21Cl2NO2 |
|---|---|
| Molecular Weight | 341.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 341.09494 |
| Heavy Atoms | 22 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 73631-12-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2OCC(CN(CCCl)CCCl)O |
| InChIKey | URWCLWXLBSIIII-UHFFFAOYSA-N |
Product Overview
Propranolol mustard (CAS 73631-12-6), with molecular formula C17H21Cl2NO2 and molecular weight 341.09 g/mol. IUPAC: 1-[bis(2-chloroethyl)amino]-3-naphthalen-1-yloxypropan-2-ol.
Chemical Property Profile of Propranolol mustard
Property Insights of Propranolol mustard
The XLogP value of 3.8 indicates that Propranolol mustard is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, Propranolol mustard exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propranolol mustard has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propranolol mustard?
The CAS number of Propranolol mustard is 73631-12-6.
What is the molecular formula of Propranolol mustard?
The molecular formula of Propranolol mustard is C17H21Cl2NO2.
What is the molecular weight of Propranolol mustard?
The molecular weight of Propranolol mustard is 341.09 g/mol.
Where can I buy Propranolol mustard?
You can request a quote for Propranolol mustard directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propranolol mustard?
Yes, KEHONG BIO provides custom synthesis services for Propranolol mustard and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.